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	hartrees
Energy at 0K	-475.609366
Energy at 298.15K	-475.613421
Nuclear repulsion energy	271.843252

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3152	2970	11.33
2	A'	1568	1477	5.51
3	A'	1509	1421	25.36
4	A'	1363	1284	139.65
5	A'	1247	1175	264.00
6	A'	1145	1079	69.22
7	A'	867	817	19.59
8	A'	669	630	31.10
9	A'	551	519	9.55
10	A'	414	390	0.77
11	A'	217	204	3.26
12	A"	3224	3038	12.54
13	A"	1366	1287	141.74
14	A"	1248	1176	62.24
15	A"	1022	963	59.47
16	A"	531	500	2.69
17	A"	359	339	1.34
18	A"	116	109	5.46

Atom	x (Å)	y (Å)	z (Å)
C1	0.353	0.198	0.000
C2	-1.153	0.239	0.000
F3	0.830	1.463	0.000
F4	0.830	-0.432	1.088
F5	0.830	-0.432	-1.088
F6	-1.626	-1.059	0.000
H7	-1.495	0.759	0.896
H8	-1.495	0.759	-0.896

	C1	C2	F3	F4	F5	F6	H7	H8
C1		1.5065	1.3519	1.3444	1.3444	2.3447	2.1297	2.1297
C2	1.5065		2.3304	2.3592	2.3592	1.3818	1.0916	1.0916
F3	1.3519	2.3304		2.1845	2.1845	3.5207	2.5900	2.5900
F4	1.3444	2.3592	2.1845		2.1754	2.7588	2.6200	3.2809
F5	1.3444	2.3592	2.1845	2.1754		2.7588	3.2809	2.6200
F6	2.3447	1.3818	3.5207	2.7588	2.7588		2.0316	2.0316
H7	2.1297	1.0916	2.5900	2.6200	3.2809	2.0316		1.7927
H8	2.1297	1.0916	2.5900	3.2809	2.6200	2.0316	1.7927

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F6	108.469	C1	C2	H7	109.072
C1	C2	H8	109.072	C2	C1	F3	109.118
C2	C1	F4	111.570	C2	C1	F5	111.570
F3	C1	F4	108.229	F3	C1	F5	108.229
F4	C1	F5	108.013	F6	C2	H7	109.895
F6	C2	H8	109.895	H7	C2	H8	110.400

All results from a given calculation for CF₃CH₂F (1,1,1,2-tetrafluoroethane)

using model chemistry: MP2=FULL/6-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CF3CH2F (1,1,1,2-tetrafluoroethane)

using model chemistry: MP2=FULL/6-31G*

States and conformations

All results from a given calculation for CF₃CH₂F (1,1,1,2-tetrafluoroethane)